5-cyano-2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylamino]-N,N-dimethyl-pyridine-3-carboxamide; ethanedioic acid

Systemtic Name: 5-cyano-2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylamino]-N,N-dimethyl-pyridine-3-carboxamide; ethanedioic acid Openeye Name: 5-cyano-2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylamino]-N,N-dimethyl-pyridine-3-carboxamide; oxalic acid CAS Name: 5-cyano-2-[3-[4-(2-methoxyphenyl)-1-piperazinyl]propylamino]-N,N-dimethyl-3-pyridinecarboxamide; oxalic acid IUPAC Name: 5-cyano-2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylamino]-N,N-dimethylpyridine-3-carboxamide; oxalic acid Traditional Name: 5-cyano-2-[3-[4-(2-methoxyphenyl)piperazino]propylamino]-N,N-dimethyl-nicotinamide; oxalic acid Formula: C25H32N6O6 MolecularWeight: 512.55818

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=C(N=CC(=C1)C#N)NCCCN2CCN(CC2)C3=CC=CC=C3OC.C(=O)(C(=O)O)O

Isomeric SMILES

CN(C)C(=O)C1=C(N=CC(=C1)C#N)NCCCN2CCN(CC2)C3=CC=CC=C3OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C23H30N6O2.C2H2O4/c1-27(2)23(30)19-15-18(16-24)17-26-22(19)25-9-6-10-28-11-13-29(14-12-28)20-7-4-5-8-21(20)31-3;3-1(4)2(5)6/h4-5,7-8,15,17H,6,9-14H2,1-3H3,(H,25,26);(H,3,4)(H,5,6)